2-ethyl-N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}butanamide
Chemical Structure Depiction of
2-ethyl-N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}butanamide
2-ethyl-N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}butanamide
Compound characteristics
| Compound ID: | C679-6516 |
| Compound Name: | 2-ethyl-N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}butanamide |
| Molecular Weight: | 414.53 |
| Molecular Formula: | C21 H26 N4 O3 S |
| Smiles: | CCCC1=NN2C(=NC(COc3cccc(c3)NC(C(CC)CC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.081 |
| logD: | 4.0769 |
| logSw: | -4.1556 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.036 |
| InChI Key: | ALBPFEFTRNRNSJ-UHFFFAOYSA-N |